CID 10751321

187401-16-7

Structural Information

Molecular Formula

C₁₃H₁₈N₂O

SMILES

CC1(CCC(C2=NC(=CN=C21)C=O)(C)C)C

InChI

InChI=1S/C13H18N2O/c1-12(2)5-6-13(3,4)11-10(12)14-7-9(8-16)15-11/h7-8H,5-6H2,1-4H3

InChIKey

JYUBFGIHUCBSRM-UHFFFAOYSA-N

Compound name

5,5,8,8-tetramethyl-6,7-dihydroquinoxaline-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 218.1419 Da
Monoisotopic Mass: 2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	219.14918	150.4
[M+Na]+	241.13112	164.2
[M+NH4]+	236.17572	161.6
[M+K]+	257.10506	153.2
[M-H]-	217.13462	152.2
[M+Na-2H]-	239.11657	158.8
[M]+	218.14135	153.3
[M]-	218.14245	153.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe